| SpectraBase Spectrum ID |
EX85Px9ZnYv |
| Name |
4H-1-Benzopyran-4-one, 7-[(o-6-deoxy-2,3,4-tri-o-methyl-.alpha.-L-mannopyranosyl-(1.fwdarw.2)-o-[6-deoxy-2,3,4-tri-o-methyl-.alpha.-L-mannopyranosyl-(1.fwdarw.4)]-3,6-di-o-methyl-.beta.-D-glucopyranosyl)oxy]-2-(3,4-dimethoxyphenyl)-5-methoxy- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
894.388529757 u |
| Formula |
C44H62O19 |
| InChI |
InChI=1S/C44H62O19/c1-21-33(50-7)36(52-9)39(55-12)42(57-21)62-35-31(20-46-3)61-44(41(38(35)54-11)63-43-40(56-13)37(53-10)34(51-8)22(2)58-43)59-24-17-29(49-6)32-25(45)19-27(60-30(32)18-24)23-14-15-26(47-4)28(16-23)48-5/h14-19,21-22,31,33-44H,20H2,1-13H3 |
| InChIKey |
GXUGSWBURNUARY-UHFFFAOYSA-N |
| Molecular Weight |
894.961 g/mol |
| SMILES |
C1(C(OC(C(C1OC)OC1C(C(OC)C(C(O1)C)OC)OC)COC)OC1=CC=2OC(C=3C=C(OC)C(=CC3)OC)=CC(C2C(=C1)OC)=O)OC1C(C(OC)C(C(O1)C)OC)OC |
![4H-1-Benzopyran-4-one, 7-[(o-6-deoxy-2,3,4-tri-o-methyl-.alpha.-L-mannopyranosyl-(1.fwdarw.2)-o-[6-deoxy-2,3,4-tri-o-methyl-.alpha.-L-mannopyranosyl-(1.fwdarw.4)]-3,6-di-o-methyl-.beta.-D-glucopyranosyl)oxy]-2-(3,4-dimethoxyphenyl)-5-methoxy-](/api/spectrum/EX85Px9ZnYv/structure.png?h=300&w=458 "4H-1-Benzopyran-4-one, 7-[(o-6-deoxy-2,3,4-tri-o-methyl-.alpha.-L-mannopyranosyl-(1.fwdarw.2)-o-[6-deoxy-2,3,4-tri-o-methyl-.alpha.-L-mannopyranosyl-(1.fwdarw.4)]-3,6-di-o-methyl-.beta.-D-glucopyranosyl)oxy]-2-(3,4-dimethoxyphenyl)-5-methoxy-")
